1-[(but-1-en-2-ylamino)methyl]cyclopentan-1-ol

C10H19NO — CID 146416378

IUPAC1-[(but-1-en-2-ylamino)methyl]cyclopentan-1-ol
SMILESC=C(CC)NCC1(O)CCCC1
InChIInChI=1S/C10H19NO/c1-3-9(2)11-8-10(12)6-4-5-7-10/h11-12H,2-8H2,1H3
InChIKeyYACNJIIRXTUDHD-UHFFFAOYSA-N
MW169.27 g/mol
LogP1.80
Rot. Bonds4

About 1-[(but-1-en-2-ylamino)methyl]cyclopentan-1-ol

1-[(but-1-en-2-ylamino)methyl]cyclopentan-1-ol (PubChem CID 146416378) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is 1-[(but-1-en-2-ylamino)methyl]cyclopentan-1-ol.

Molecular Properties

Compound Name1-[(but-1-en-2-ylamino)methyl]cyclopentan-1-ol
PubChem CID146416378
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC Name1-[(but-1-en-2-ylamino)methyl]cyclopentan-1-ol
SMILESC=C(CC)NCC1(O)CCCC1
InChIInChI=1S/C10H19NO/c1-3-9(2)11-8-10(12)6-4-5-7-10/h11-12H,2-8H2,1H3
InChIKeyYACNJIIRXTUDHD-UHFFFAOYSA-N
XLogP1.80
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 51.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-[(Pent-4-enylamino)methyl]cyclopentan-1-ol
CID 65111065
1-[(But-3-enylamino)methyl]cyclopentan-1-ol
CID 65111685
1-[(2-Methylidenebutylamino)methyl]cyclopentan-1-ol
CID 66045240
1-[(Hept-6-en-3-ylamino)methyl]cyclopentan-1-ol
CID 75428093
1-[[[(3S)-hept-6-en-3-yl]amino]methyl]cyclopentan-1-ol
CID 97322404
1-[[[(3R)-hept-6-en-3-yl]amino]methyl]cyclopentan-1-ol
CID 97322405
1-[(Hex-5-en-2-ylamino)methyl]cyclopentan-1-ol
CID 104582440
1-[(Hept-6-enylamino)methyl]cyclopentan-1-ol
CID 107006900
1-[(3-Methylhex-5-en-2-ylamino)methyl]cyclopentan-1-ol
CID 112322787
1-[(Oct-7-en-4-ylamino)methyl]cyclopentan-1-ol
CID 112322856
1-[(3-Methylbut-3-enylamino)methyl]cyclopentan-1-ol
CID 114472356
1-[[[(E)-pent-3-enyl]amino]methyl]cyclopentan-1-ol
CID 116034143

Frequently Asked Questions

What is the IUPAC name of 1-[(but-1-en-2-ylamino)methyl]cyclopentan-1-ol?
The IUPAC name of 1-[(but-1-en-2-ylamino)methyl]cyclopentan-1-ol (CID 146416378) is 1-[(but-1-en-2-ylamino)methyl]cyclopentan-1-ol.
What is the SMILES notation for 1-[(but-1-en-2-ylamino)methyl]cyclopentan-1-ol?
The canonical SMILES for 1-[(but-1-en-2-ylamino)methyl]cyclopentan-1-ol is C=C(CC)NCC1(O)CCCC1.
What is the InChIKey of 1-[(but-1-en-2-ylamino)methyl]cyclopentan-1-ol?
The InChIKey is YACNJIIRXTUDHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO/c1-3-9(2)11-8-10(12)6-4-5-7-10/h11-12H,2-8H2,1H3.
What are the key properties of 1-[(but-1-en-2-ylamino)methyl]cyclopentan-1-ol?
1-[(but-1-en-2-ylamino)methyl]cyclopentan-1-ol has a molecular weight of 169.27 g/mol, XLogP of 1.80, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(but-1-en-2-ylamino)methyl]cyclopentan-1-ol is sourced from PubChem (CID 146416378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).