N-(cyclopropylmethyl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)piperidin-4-amine

C19H28N2 — CID 115306943

IUPACN-(cyclopropylmethyl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)piperidin-4-amine
SMILESc1ccc2c(c1)CCC(N1CCC(NCC3CC3)CC1)C2
InChIInChI=1S/C19H28N2/c1-2-4-17-13-19(8-7-16(17)3-1)21-11-9-18(10-12-21)20-14-15-5-6-15/h1-4,15,18-20H,5-14H2
InChIKeyZKKVMKSUZQXESC-UHFFFAOYSA-N
MW284.45 g/mol
LogP3.01
Rot. Bonds4

About N-(cyclopropylmethyl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)piperidin-4-amine

N-(cyclopropylmethyl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)piperidin-4-amine (PubChem CID 115306943) has the molecular formula C19H28N2 and a molecular weight of 284.45 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)piperidin-4-amine.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)piperidin-4-amine
PubChem CID115306943
Molecular FormulaC19H28N2
Molecular Weight284.45 g/mol
Exact Mass284.23
IUPAC NameN-(cyclopropylmethyl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)piperidin-4-amine
SMILESc1ccc2c(c1)CCC(N1CCC(NCC3CC3)CC1)C2
InChIInChI=1S/C19H28N2/c1-2-4-17-13-19(8-7-16(17)3-1)21-11-9-18(10-12-21)20-14-15-5-6-15/h1-4,15,18-20H,5-14H2
InChIKeyZKKVMKSUZQXESC-UHFFFAOYSA-N
XLogP3.01
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.45
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(cyclobutylmethyl)-1,2,3,4-tetrahydronaphthalen-2-amine
CID 43775224
4-[(1,2,3,4-tetrahydronaphthalen-2-ylamino)methyl]cyclohexan-1-ol
CID 106127210
1-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrrolidin-3-amine
CID 62068570
3-[1-(1,2,3,4-tetrahydronaphthalen-2-yl)piperidin-4-yl]propanoic acid
CID 65059978
1-(1,2,3,4-tetrahydronaphthalen-2-yl)piperazine
CID 3596803
2-[4-(1,2,3,4-tetrahydronaphthalen-2-yl)piperazin-1-yl]acetic acid
CID 56701450
N-(cyclopropylmethyl)-1-(1-methylpiperidin-4-yl)piperidin-4-amine
CID 78921372
N'-cyclopropyl-N-(1,2,3,4-tetrahydronaphthalen-2-ylmethyl)ethane-1,2-diamine
CID 107126609
N-[(1-cyclopropylpiperidin-4-yl)methyl]cyclopropanamine
CID 83907747
2-[[4-[(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]piperazine-1-carbonyl]amino]acetic acid
CID 126434125
1-(2-methoxyphenyl)-4-[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]piperazine
CID 7441356
3-(1,2,3,4-tetrahydronaphthalen-2-yl)-3,9-diazabicyclo[4.2.1]nonane
CID 115313813

Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)piperidin-4-amine?
The IUPAC name of N-(cyclopropylmethyl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)piperidin-4-amine (CID 115306943) is N-(cyclopropylmethyl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)piperidin-4-amine.
What is the SMILES notation for N-(cyclopropylmethyl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)piperidin-4-amine?
The canonical SMILES for N-(cyclopropylmethyl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)piperidin-4-amine is c1ccc2c(c1)CCC(N1CCC(NCC3CC3)CC1)C2.
What is the InChIKey of N-(cyclopropylmethyl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)piperidin-4-amine?
The InChIKey is ZKKVMKSUZQXESC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28N2/c1-2-4-17-13-19(8-7-16(17)3-1)21-11-9-18(10-12-21)20-14-15-5-6-15/h1-4,15,18-20H,5-14H2.
What are the key properties of N-(cyclopropylmethyl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)piperidin-4-amine?
N-(cyclopropylmethyl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)piperidin-4-amine has a molecular weight of 284.45 g/mol, XLogP of 3.01, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)piperidin-4-amine is sourced from PubChem (CID 115306943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).