1-cyclopropyl-N-[(1S,2R)-2-methyl-1,2,3,4-tetrahydronaphthalen-1-yl]piperidin-4-amine

C19H28N2 — CID 97257089

IUPAC1-cyclopropyl-N-[(1S,2R)-2-methyl-1,2,3,4-tetrahydronaphthalen-1-yl]piperidin-4-amine
SMILESC[C@@H]1CCc2ccccc2[C@H]1NC1CCN(C2CC2)CC1
InChIInChI=1S/C19H28N2/c1-14-6-7-15-4-2-3-5-18(15)19(14)20-16-10-12-21(13-11-16)17-8-9-17/h2-5,14,16-17,19-20H,6-13H2,1H3/t14-,19+/m1/s1
InChIKeyOHPNIQDMLSLDPM-KUHUBIRLSA-N
MW284.45 g/mol
LogP3.53
Rot. Bonds3

About 1-cyclopropyl-N-[(1S,2R)-2-methyl-1,2,3,4-tetrahydronaphthalen-1-yl]piperidin-4-amine

1-cyclopropyl-N-[(1S,2R)-2-methyl-1,2,3,4-tetrahydronaphthalen-1-yl]piperidin-4-amine (PubChem CID 97257089) has the molecular formula C19H28N2 and a molecular weight of 284.45 g/mol. Its IUPAC name is 1-cyclopropyl-N-[(1S,2R)-2-methyl-1,2,3,4-tetrahydronaphthalen-1-yl]piperidin-4-amine.

Molecular Properties

Compound Name1-cyclopropyl-N-[(1S,2R)-2-methyl-1,2,3,4-tetrahydronaphthalen-1-yl]piperidin-4-amine
PubChem CID97257089
Molecular FormulaC19H28N2
Molecular Weight284.45 g/mol
Exact Mass284.23
IUPAC Name1-cyclopropyl-N-[(1S,2R)-2-methyl-1,2,3,4-tetrahydronaphthalen-1-yl]piperidin-4-amine
SMILESC[C@@H]1CCc2ccccc2[C@H]1NC1CCN(C2CC2)CC1
InChIInChI=1S/C19H28N2/c1-14-6-7-15-4-2-3-5-18(15)19(14)20-16-10-12-21(13-11-16)17-8-9-17/h2-5,14,16-17,19-20H,6-13H2,1H3/t14-,19+/m1/s1
InChIKeyOHPNIQDMLSLDPM-KUHUBIRLSA-N
XLogP3.53
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.45
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-N-[(1S,2R)-2-methyl-1,2,3,4-tetrahydronaphthalen-1-yl]piperidin-4-amine?
The IUPAC name of 1-cyclopropyl-N-[(1S,2R)-2-methyl-1,2,3,4-tetrahydronaphthalen-1-yl]piperidin-4-amine (CID 97257089) is 1-cyclopropyl-N-[(1S,2R)-2-methyl-1,2,3,4-tetrahydronaphthalen-1-yl]piperidin-4-amine.
What is the SMILES notation for 1-cyclopropyl-N-[(1S,2R)-2-methyl-1,2,3,4-tetrahydronaphthalen-1-yl]piperidin-4-amine?
The canonical SMILES for 1-cyclopropyl-N-[(1S,2R)-2-methyl-1,2,3,4-tetrahydronaphthalen-1-yl]piperidin-4-amine is C[C@@H]1CCc2ccccc2[C@H]1NC1CCN(C2CC2)CC1.
What is the InChIKey of 1-cyclopropyl-N-[(1S,2R)-2-methyl-1,2,3,4-tetrahydronaphthalen-1-yl]piperidin-4-amine?
The InChIKey is OHPNIQDMLSLDPM-KUHUBIRLSA-N. The full InChI is InChI=1S/C19H28N2/c1-14-6-7-15-4-2-3-5-18(15)19(14)20-16-10-12-21(13-11-16)17-8-9-17/h2-5,14,16-17,19-20H,6-13H2,1H3/t14-,19+/m1/s1.
What are the key properties of 1-cyclopropyl-N-[(1S,2R)-2-methyl-1,2,3,4-tetrahydronaphthalen-1-yl]piperidin-4-amine?
1-cyclopropyl-N-[(1S,2R)-2-methyl-1,2,3,4-tetrahydronaphthalen-1-yl]piperidin-4-amine has a molecular weight of 284.45 g/mol, XLogP of 3.53, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-N-[(1S,2R)-2-methyl-1,2,3,4-tetrahydronaphthalen-1-yl]piperidin-4-amine is sourced from PubChem (CID 97257089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).