1-amino-N-spiro[3,4-dihydrochromene-2,1'-cyclopentane]-4-ylcyclopentane-1-carboxamide

C19H26N2O2 — CID 119341963

IUPAC1-amino-N-spiro[3,4-dihydrochromene-2,1'-cyclopentane]-4-ylcyclopentane-1-carboxamide
SMILESNC1(C(=O)NC2CC3(CCCC3)Oc3ccccc32)CCCC1
InChIInChI=1S/C19H26N2O2/c20-19(11-5-6-12-19)17(22)21-15-13-18(9-3-4-10-18)23-16-8-2-1-7-14(15)16/h1-2,7-8,15H,3-6,9-13,20H2,(H,21,22)
InChIKeyVRCXRCTZVNJTHT-UHFFFAOYSA-N
MW314.43 g/mol
LogP3.21
Rot. Bonds2

About 1-amino-N-spiro[3,4-dihydrochromene-2,1'-cyclopentane]-4-ylcyclopentane-1-carboxamide

1-amino-N-spiro[3,4-dihydrochromene-2,1'-cyclopentane]-4-ylcyclopentane-1-carboxamide (PubChem CID 119341963) has the molecular formula C19H26N2O2 and a molecular weight of 314.43 g/mol. Its IUPAC name is 1-amino-N-spiro[3,4-dihydrochromene-2,1'-cyclopentane]-4-ylcyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-amino-N-spiro[3,4-dihydrochromene-2,1'-cyclopentane]-4-ylcyclopentane-1-carboxamide
PubChem CID119341963
Molecular FormulaC19H26N2O2
Molecular Weight314.43 g/mol
Exact Mass314.20
IUPAC Name1-amino-N-spiro[3,4-dihydrochromene-2,1'-cyclopentane]-4-ylcyclopentane-1-carboxamide
SMILESNC1(C(=O)NC2CC3(CCCC3)Oc3ccccc32)CCCC1
InChIInChI=1S/C19H26N2O2/c20-19(11-5-6-12-19)17(22)21-15-13-18(9-3-4-10-18)23-16-8-2-1-7-14(15)16/h1-2,7-8,15H,3-6,9-13,20H2,(H,21,22)
InChIKeyVRCXRCTZVNJTHT-UHFFFAOYSA-N
XLogP3.21
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.43
LogP ≤ 53.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-hydroxy-N-[(4R)-spiro[3,4-dihydrochromene-2,1'-cyclopentane]-4-yl]acetamide
CID 99974584
2-hydroxy-N-spiro[3,4-dihydrochromene-2,1'-cyclopentane]-4-ylacetamide
CID 86285388
3-amino-N-spiro[3,4-dihydrochromene-2,1'-cyclopentane]-4-ylpropanamide;hydrochloride
CID 119341948
(2S)-2-amino-3-methyl-N-spiro[3,4-dihydrochromene-2,1'-cyclopentane]-4-ylbutanamide
CID 119341975
3-amino-2-methyl-N-spiro[3,4-dihydrochromene-2,1'-cyclopentane]-4-ylbutanamide
CID 120502115
2-(4-ethylphenyl)-N-spiro[3,4-dihydrochromene-2,1'-cyclohexane]-4-ylacetamide
CID 133224868
(2R)-N-[(4R)-spiro[3,4-dihydrochromene-2,1'-cyclopentane]-4-yl]oxolane-2-carboxamide
CID 51494028
N-spiro[3,4-dihydrochromene-2,1'-cyclopentane]-4-yloxolane-2-carboxamide
CID 46958893
3-amino-N-spiro[3,4-dihydrochromene-2,1'-cyclopentane]-4-ylbenzamide;hydrochloride
CID 119815673
2-(2-fluorophenyl)-N-spiro[3,4-dihydrochromene-2,1'-cyclohexane]-4-ylacetamide
CID 133166982
1-propyl-3-spiro[3,4-dihydrochromene-2,1'-cyclohexane]-4-ylurea
CID 126468272
3-(2-aminopyrimidin-5-yl)-N-spiro[3,4-dihydrochromene-2,1'-cyclohexane]-4-ylprop-2-enamide
CID 171140030

Frequently Asked Questions

What is the IUPAC name of 1-amino-N-spiro[3,4-dihydrochromene-2,1'-cyclopentane]-4-ylcyclopentane-1-carboxamide?
The IUPAC name of 1-amino-N-spiro[3,4-dihydrochromene-2,1'-cyclopentane]-4-ylcyclopentane-1-carboxamide (CID 119341963) is 1-amino-N-spiro[3,4-dihydrochromene-2,1'-cyclopentane]-4-ylcyclopentane-1-carboxamide.
What is the SMILES notation for 1-amino-N-spiro[3,4-dihydrochromene-2,1'-cyclopentane]-4-ylcyclopentane-1-carboxamide?
The canonical SMILES for 1-amino-N-spiro[3,4-dihydrochromene-2,1'-cyclopentane]-4-ylcyclopentane-1-carboxamide is NC1(C(=O)NC2CC3(CCCC3)Oc3ccccc32)CCCC1.
What is the InChIKey of 1-amino-N-spiro[3,4-dihydrochromene-2,1'-cyclopentane]-4-ylcyclopentane-1-carboxamide?
The InChIKey is VRCXRCTZVNJTHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N2O2/c20-19(11-5-6-12-19)17(22)21-15-13-18(9-3-4-10-18)23-16-8-2-1-7-14(15)16/h1-2,7-8,15H,3-6,9-13,20H2,(H,21,22).
What are the key properties of 1-amino-N-spiro[3,4-dihydrochromene-2,1'-cyclopentane]-4-ylcyclopentane-1-carboxamide?
1-amino-N-spiro[3,4-dihydrochromene-2,1'-cyclopentane]-4-ylcyclopentane-1-carboxamide has a molecular weight of 314.43 g/mol, XLogP of 3.21, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-spiro[3,4-dihydrochromene-2,1'-cyclopentane]-4-ylcyclopentane-1-carboxamide is sourced from PubChem (CID 119341963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).