5-chloro-N-(cyclopropylmethyl)-N-ethyl-6-(ethylaminomethyl)pyridin-2-amine

C14H22ClN3 — CID 63938138

IUPAC5-chloro-N-(cyclopropylmethyl)-N-ethyl-6-(ethylaminomethyl)pyridin-2-amine
SMILESCCNCc1nc(N(CC)CC2CC2)ccc1Cl
InChIInChI=1S/C14H22ClN3/c1-3-16-9-13-12(15)7-8-14(17-13)18(4-2)10-11-5-6-11/h7-8,11,16H,3-6,9-10H2,1-2H3
InChIKeyCKGZBOXKVGSKAO-UHFFFAOYSA-N
MW267.80 g/mol
LogP3.08
Rot. Bonds7

About 5-chloro-N-(cyclopropylmethyl)-N-ethyl-6-(ethylaminomethyl)pyridin-2-amine

5-chloro-N-(cyclopropylmethyl)-N-ethyl-6-(ethylaminomethyl)pyridin-2-amine (PubChem CID 63938138) has the molecular formula C14H22ClN3 and a molecular weight of 267.80 g/mol. Its IUPAC name is 5-chloro-N-(cyclopropylmethyl)-N-ethyl-6-(ethylaminomethyl)pyridin-2-amine.

Molecular Properties

Compound Name5-chloro-N-(cyclopropylmethyl)-N-ethyl-6-(ethylaminomethyl)pyridin-2-amine
PubChem CID63938138
Molecular FormulaC14H22ClN3
Molecular Weight267.80 g/mol
Exact Mass267.15
IUPAC Name5-chloro-N-(cyclopropylmethyl)-N-ethyl-6-(ethylaminomethyl)pyridin-2-amine
SMILESCCNCc1nc(N(CC)CC2CC2)ccc1Cl
InChIInChI=1S/C14H22ClN3/c1-3-16-9-13-12(15)7-8-14(17-13)18(4-2)10-11-5-6-11/h7-8,11,16H,3-6,9-10H2,1-2H3
InChIKeyCKGZBOXKVGSKAO-UHFFFAOYSA-N
XLogP3.08
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.80
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-chloro-N-ethyl-6-(ethylaminomethyl)-N-(2-ethylbutyl)pyridin-2-amine
CID 63489637
5-chloro-N-ethyl-6-(ethylaminomethyl)-N-(pyridin-4-ylmethyl)pyridin-2-amine
CID 62292980
5-chloro-N-cyclohexyl-6-(ethylaminomethyl)-N-methylpyridin-2-amine
CID 62285473
5-chloro-N-(1-cyclopropylethyl)-6-(ethylaminomethyl)-N-methylpyridin-2-amine
CID 62282227
5-chloro-6-(ethylaminomethyl)-N-methyl-N-pentan-3-ylpyridin-2-amine
CID 62283603
5-chloro-N-ethyl-N-(2-methylpropyl)-6-[(2-methylpropylamino)methyl]pyridin-2-amine
CID 62280243
N-butyl-5-chloro-N-ethyl-6-(propylaminomethyl)pyridin-2-amine
CID 55054566
6-[(tert-butylamino)methyl]-5-chloro-N-(cyclopropylmethyl)-N-methylpyridin-2-amine
CID 62283149
5-chloro-N-ethyl-N-(2-methylpropyl)-6-[(propan-2-ylamino)methyl]pyridin-2-amine
CID 62280062
N-(cyclopropylmethyl)-N-ethyl-4-(ethylaminomethyl)pyridin-2-amine
CID 63940447
5-chloro-6-(ethylaminomethyl)-N-methyl-N-pentan-2-ylpyridin-2-amine
CID 62282594
[3-chloro-6-[ethyl(oxolan-2-ylmethyl)amino]-2-pyridinyl]methanol
CID 61435500

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(cyclopropylmethyl)-N-ethyl-6-(ethylaminomethyl)pyridin-2-amine?
The IUPAC name of 5-chloro-N-(cyclopropylmethyl)-N-ethyl-6-(ethylaminomethyl)pyridin-2-amine (CID 63938138) is 5-chloro-N-(cyclopropylmethyl)-N-ethyl-6-(ethylaminomethyl)pyridin-2-amine.
What is the SMILES notation for 5-chloro-N-(cyclopropylmethyl)-N-ethyl-6-(ethylaminomethyl)pyridin-2-amine?
The canonical SMILES for 5-chloro-N-(cyclopropylmethyl)-N-ethyl-6-(ethylaminomethyl)pyridin-2-amine is CCNCc1nc(N(CC)CC2CC2)ccc1Cl.
What is the InChIKey of 5-chloro-N-(cyclopropylmethyl)-N-ethyl-6-(ethylaminomethyl)pyridin-2-amine?
The InChIKey is CKGZBOXKVGSKAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22ClN3/c1-3-16-9-13-12(15)7-8-14(17-13)18(4-2)10-11-5-6-11/h7-8,11,16H,3-6,9-10H2,1-2H3.
What are the key properties of 5-chloro-N-(cyclopropylmethyl)-N-ethyl-6-(ethylaminomethyl)pyridin-2-amine?
5-chloro-N-(cyclopropylmethyl)-N-ethyl-6-(ethylaminomethyl)pyridin-2-amine has a molecular weight of 267.80 g/mol, XLogP of 3.08, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(cyclopropylmethyl)-N-ethyl-6-(ethylaminomethyl)pyridin-2-amine is sourced from PubChem (CID 63938138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).